Vitas-M small molecule compound

(2E)-3-{3-[(3-hydroxypropyl)sulfamoyl]-4-methoxyphenyl}prop-2-enoic acid

Catalog ID
STK534321
SMILES OCCCNS(=O)(=O)c1cc(/C=C/C(=O)O)ccc1OC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H17NO6S MW 315.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17NO6S/c1-20-11-5-3-10(4-6-13(16)17)9-12(11)21(18,19)14-7-2-8-15/h3-6,9,14-15H,2,7-8H2,1H3,(H,16,17)/b6-4+
InChIKey
AFLPWHOCBJZSFL-GQCTYLIASA-N
Synonyms
299954-30-6
(2E)3(3(((3HYDROXYPROPYL)AMINO)SULFONYL)4METHOXYPHENYL)ACRYLICACID
(2E)3(3(((3HYDROXYPROPYL)AMINO)SULFONYL)4METHOXYPHENYL)PROP2ENOICACID
(2E)3(3((3hydroxypropyl)sulfamoyl)4methoxyphenyl)prop2enoicacid
(E)3(3(3HYDROXYPROPYLSULFAMOYL)4METHOXYPHENYL)PROP2ENOICACID
(E)3(3(N(3hydroxypropyl)sulfamoyl)4methoxyphenyl)acrylicacid
299954306
3(3(3HYDROXYPROPYLSULFAMOYL)4METHOXYPHENYL)ACRYLICACID
COC1=C(C=C(C=C1)C=CC(=O)O)S(=O)(=O)NCCCO
InChI=1SC13H17NO6Sc120115310(4613(16)17)912(11)21(1819)1472815h3691415H278H21H3(H1617)b64+
MFCD00786064
OCCCNS(=O)(=O)c1cc(C=CC(=O)O)ccc1OC
ZINC000001812465
ZINC1812465

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.